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. 2020 Jan 29;15(3):324–337. doi: 10.1002/cmdc.201900604

Figure 17.

Figure 17

The published structure of TGT in complex with J64 (yellow, PDB: 5N6F) superimposed with one orientation of J50 (pink). The piperidine ring clashes with Ala232, demonstrating the unfavorable binding of the fragment in the binding pocket of TGT.